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CAS 836-12-4

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{[4-oxo-6-(trifluoromethyl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetic acid

Description:
The chemical substance known as {[4-oxo-6-(trifluoromethyl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetic acid, with the CAS number 836-12-4, is a heterocyclic compound featuring a pyrimidine ring. This compound is characterized by the presence of a trifluoromethyl group, which enhances its lipophilicity and can influence its biological activity. The sulfonyl group attached to the pyrimidine ring contributes to its reactivity and potential applications in medicinal chemistry. The carboxylic acid functional group in the structure provides acidic properties, allowing for potential interactions in biological systems. This compound may exhibit various pharmacological activities, making it of interest in drug development. Its unique structural features, including the combination of heteroatoms and functional groups, suggest potential applications in areas such as agrochemicals or pharmaceuticals. As with many chemical substances, its stability, solubility, and reactivity can be influenced by environmental conditions and the presence of other chemical entities.
Formula:C7H5F3N2O3S
InChI:InChI=1/C7H5F3N2O3S/c8-7(9,10)3-1-4(13)12-6(11-3)16-2-5(14)15/h1H,2H2,(H,14,15)(H,11,12,13)
SMILES:c1c(C(F)(F)F)nc(nc1O)SCC(=O)O
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